4-[4-[(3S)-4-cyclobutyl-3-methyl-piperazin-1-yl]carbonylpiperidin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[(3S)-4-cyclobutyl-3-methyl-piperazin-1-yl]carbonylpiperidin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-[(3S)-4-cyclobutyl-3-methyl-piperazine-1-carbonyl]-1-piperidyl]benzonitrile CAS Name: 4-[4-[[(3S)-4-cyclobutyl-3-methyl-1-piperazinyl]-oxomethyl]-1-piperidinyl]benzonitrile IUPAC Name: 4-[4-[(3S)-4-cyclobutyl-3-methylpiperazine-1-carbonyl]piperidin-1-yl]benzonitrile Traditional Name: 4-[4-[(3S)-4-cyclobutyl-3-methyl-piperazine-1-carbonyl]piperidino]benzonitrile Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2CCC2)C(=O)C3CCN(CC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C[C@H]1CN(CCN1C2CCC2)C(=O)C3CCN(CC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H30N4O/c1-17-16-25(13-14-26(17)21-3-2-4-21)22(27)19-9-11-24(12-10-19)20-7-5-18(15-23)6-8-20/h5-8,17,19,21H,2-4,9-14,16H2,1H3/t17-/m0/s1